Predicted protein targets (top 9)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | SLC6A4 | P31645 | 20/20 | 0.50 |
| ▸ | SLC6A2 | P23975 | 15/20 | 0.45 |
| ▸ | SLC6A3 | Q01959 | 6/20 | 0.43 |
| ▸ | CYP2D6 | P10635 | 2/20 | 0.40 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.40 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.40 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.40 |
| ▸ | HTR7 | P34969 | 1/20 | 0.38 |
| ▸ | KCNH2 | Q12809 | 1/20 | 0.38 |
Click a target to see other patent compounds predicted against it — the reverse direction, in place.
Similar compounds — the chemically nearest patent molecules
Nearest neighbours by Morgan-fingerprint cosine across the patent-compound collection, with each neighbour's top predicted target and the predicted targets it shares with this molecule.
| Compound | similarity | top predicted | shared targets | |
|---|---|---|---|---|
| SCHEMBL27782829 | 0.84 | SLC6A4 (0.69) | SLC6A4SLC6A2SLC6A3CYP2D6CYP1A2 | |
| SCHEMBL9816200 | 0.84 | SLC6A4 (0.69) | SLC6A4SLC6A2SLC6A3CYP2D6CYP1A2 | |
| SCHEMBL8907832 | 0.81 | SLC6A2 (0.56) | SLC6A4SLC6A2SLC6A3CYP2D6KCNH2 | |
| SCHEMBL2173663 | 0.81 | SLC6A4 (0.49) | SLC6A4SLC6A2SLC6A3CYP2D6CYP1A2 | |
| SCHEMBL12806778 | 0.75 | SLC6A4 (0.66) | SLC6A4SLC6A2SLC6A3CYP2D6CYP1A2 | |
| SCHEMBL4764075 | 0.75 | MEN1 (0.43) | SLC6A4SLC6A2SLC6A3CYP2D6HTR7 | |
| SCHEMBL4307025 | 0.75 | SLC6A4 (0.43) | SLC6A4SLC6A2SLC6A3CYP2D6CYP1A2 | |
| SCHEMBL28140496 | 0.74 | MEN1 (0.46) | SLC6A4SLC6A2SLC6A3CYP2D6 | |
| SCHEMBL12806751 | 0.74 | SLC6A4 (0.64) | SLC6A4SLC6A2SLC6A3CYP2D6CYP1A2 | |
| SCHEMBL12806785 | 0.73 | SLC6A4 (0.55) | SLC6A4SLC6A2SLC6A3CYP2D6CYP1A2 |
Similarity is cosine over the 2,048-bit Morgan fingerprint (≈ Tanimoto). Identical fingerprints score 1.00.
Patent provenance — the patents this molecule appears in, and who filed them
Claimed or disclosed in 2 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-1962830-A2 | AZAINDOLE INHIBITORS OF AURORA KINASES | SmithKline Beecham Corporation (US) | 2008-09-03 | — | — | EP | disclosed |
| WO-2007076348-A2 | AZAINDOLE INHIBITORS OF AURORA KINASES | SMITHKLINE BEECHAM CORPORATION (US) | 2007-07-05 | — | — | WO | disclosed |